N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide

C14H15N3O3 — CID 110715371

IUPACN-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide
SMILESCN1C(=O)NC(c2cccc(NC(=O)C3CC3)c2)C1=O
InChIInChI=1S/C14H15N3O3/c1-17-13(19)11(16-14(17)20)9-3-2-4-10(7-9)15-12(18)8-5-6-8/h2-4,7-8,11H,5-6H2,1H3,(H,15,18)(H,16,20)
InChIKeyKOGARODBESYWDD-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.26
Rot. Bonds3

About N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide

N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide (PubChem CID 110715371) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide
PubChem CID110715371
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC NameN-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide
SMILESCN1C(=O)NC(c2cccc(NC(=O)C3CC3)c2)C1=O
InChIInChI=1S/C14H15N3O3/c1-17-13(19)11(16-14(17)20)9-3-2-4-10(7-9)15-12(18)8-5-6-8/h2-4,7-8,11H,5-6H2,1H3,(H,15,18)(H,16,20)
InChIKeyKOGARODBESYWDD-UHFFFAOYSA-N
XLogP1.26
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]-2-phenylacetamide
CID 110715395
phenyl N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]carbamate
CID 110715408
N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]pyrazine-2-carboxamide
CID 110742560
ethyl 6-[3-(cyclopropanecarbonylamino)phenyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate
CID 42763347
4-fluoro-N-[3-[(4-fluorocyclohexanecarbonyl)amino]phenyl]cyclohexane-1-carboxamide
CID 171577056
(2S,4R)-2-methyl-N-[3-[(4-methylcyclohexanecarbonyl)amino]phenyl]-6-oxopiperidine-4-carboxamide
CID 166375292
N-[3-(propan-2-ylamino)phenyl]cyclopropanecarboxamide
CID 28620650
N-[3-(2,2-dimethylpropanoylamino)phenyl]cyclopropanecarboxamide
CID 17204538
N-(3-acetamidophenyl)cyclobutanecarboxamide
CID 2666370
N-[3-(propanoylamino)phenyl]piperidine-4-carboxamide
CID 54794417
methyl 3-butyl-6-[3-(cyclobutanecarbonylamino)phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
CID 42756649
N-(3-formamidophenyl)cyclopropanecarboxamide
CID 64991224

Frequently Asked Questions

What is the IUPAC name of N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide (CID 110715371) is N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide is CN1C(=O)NC(c2cccc(NC(=O)C3CC3)c2)C1=O.
What is the InChIKey of N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide?
The InChIKey is KOGARODBESYWDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-17-13(19)11(16-14(17)20)9-3-2-4-10(7-9)15-12(18)8-5-6-8/h2-4,7-8,11H,5-6H2,1H3,(H,15,18)(H,16,20).
What are the key properties of N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide?
N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide has a molecular weight of 273.29 g/mol, XLogP of 1.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 110715371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).